Acetone → HCID 13457142, 화합물

HRID 666135

반응식

HRID 666135 반응식
[CH3:29][C:30](=[O:31])[CH3:32].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[Cl:14][c:15]1[c:16]([CH2:27][OH:28])[cH:17][cH:18][c:19]([N:21]2[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]2)[cH:20]1.[Cl:1][CH2:2][CH2:3][CH2:4][C:5](=[O:6])[c:7]1[cH:8][cH:9][c:10]([Cl:13])[cH:11][cH:12]1>>[CH2:2]([CH2:3][CH2:4][C:5](=[O:6])[c:7]1[cH:8][cH:9][c:10]([Cl:13])[cH:11][cH:12]1)[N:24]1[CH2:23][CH2:22][N:21]([c:19]2[cH:18][cH:17][c:16]([CH2:27][OH:28])[c:15]([Cl:14])[cH:20]2)[CH2:26][CH2:25]1

참가 물질

5

출처 및 근거

ORD 기록
ord-a26bb188f6cc44ac88602754df45f003
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

불러오는 중…